6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide

C20H16ClFN2O2 — CID 58639534

IUPAC6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(Cl)cc1-c1ccc(C(=O)Nc2ccc(C)c(F)c2)cn1
InChIInChI=1S/C20H16ClFN2O2/c1-12-3-6-15(10-17(12)22)24-20(25)13-4-7-18(23-11-13)16-9-14(21)5-8-19(16)26-2/h3-11H,1-2H3,(H,24,25)
InChIKeyVVGGERAOHWQJFH-UHFFFAOYSA-N
MW370.81 g/mol
LogP5.11
Rot. Bonds4

About 6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide

6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide (PubChem CID 58639534) has the molecular formula C20H16ClFN2O2 and a molecular weight of 370.81 g/mol. Its IUPAC name is 6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide
PubChem CID58639534
Molecular FormulaC20H16ClFN2O2
Molecular Weight370.81 g/mol
Exact Mass370.09
IUPAC Name6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(Cl)cc1-c1ccc(C(=O)Nc2ccc(C)c(F)c2)cn1
InChIInChI=1S/C20H16ClFN2O2/c1-12-3-6-15(10-17(12)22)24-20(25)13-4-7-18(23-11-13)16-9-14(21)5-8-19(16)26-2/h3-11H,1-2H3,(H,24,25)
InChIKeyVVGGERAOHWQJFH-UHFFFAOYSA-N
XLogP5.11
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.81
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-chloro-5-fluorophenyl)-N-[(3,4-dimethoxyphenyl)methyl]-2-pyridin-3-ylpyridine-3-carboxamide
CID 25060657
6-(2-fluoranylpyridin-4-yl)-~{N}-[(1~{R})-1-(3-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 168276974
N-[4-(2-Chloro-benzyloxy)-phenyl]-nicotinamide
CID 803928
5-chloro-2-methoxy-N-5-quinolinylbenzamide
CID 974232
5-chloro-N-(2-chloropyridin-3-yl)-2-methoxybenzamide
CID 3154652
2-methoxy-N-[4-(4-pyridinylmethyl)phenyl]benzamide
CID 776740
2-(benzyloxy)-5-chloro-N-pyridin-3-ylbenzamide
CID 6463365
3-{2-[5-Chloro-2-(benzyloxy)-phenyl]-5-methyl-pyrrol-1-yl}-N-(pyridin-2-ylmethyl)-benzamide
CID 10051975
5-(2-(2-(4-Fluorobenzyloxy)-5-chlorophenyl)cyclopent-1-enyl)-2-methylnicotinic acid
CID 44430775
4-{2-[5-Chloro-2-(benzyloxy)-phenyl]-5-methyl-pyrrol-1-yl}-N-(pyridin-2-ylmethyl)-benzamide
CID 44432348
4-[2-(5-chloro-2-phenylmethoxyphenyl)-5-methylpyrrol-1-yl]-N-(pyridin-3-ylmethyl)benzamide
CID 44432350
4-{2-[5-Chloro-2-(benzyloxy)-phenyl]-5-methyl-pyrrol-1-yl}-N-(pyridin-4-ylmethyl)-benzamide
CID 44432353

Frequently Asked Questions

What is the IUPAC name of 6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide (CID 58639534) is 6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide is COc1ccc(Cl)cc1-c1ccc(C(=O)Nc2ccc(C)c(F)c2)cn1.
What is the InChIKey of 6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide?
The InChIKey is VVGGERAOHWQJFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClFN2O2/c1-12-3-6-15(10-17(12)22)24-20(25)13-4-7-18(23-11-13)16-9-14(21)5-8-19(16)26-2/h3-11H,1-2H3,(H,24,25).
What are the key properties of 6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide?
6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide has a molecular weight of 370.81 g/mol, XLogP of 5.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-chloro-2-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 58639534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).